6-[(2-phenylethyl)sulfanyl]-9H-purine structure

6-[(2-phenylethyl)sulfanyl]-9H-purine

6-(2-phenylethylsulfanyl)-7H-purine

Also Known As: CBMicro_013667|ChemDiv2_003244|6-[(2-phenylethyl)sulfanyl]-9H-purine|6-(2-phenylethylthio)purine|Oprea1_532013|Oprea1_874942|6-(phenethylthio)-9h-purine|6-phenethylsulfanyl-5H-purine|6-phenethylsulfanyl-7H-purine|6-(2-phenylethylsulfanyl)-7H-purine|7H-Purine, 6-(2-phenethyl)thio-|1H-Purine, 6-[(2-phenylethyl)thio]-|1H-Purine, 6-((2-phenylethyl)thio)-|6-[(2-Phenylethyl)sulfanyl]-7H-purine|BIM-0013613.P001|6-[(2-Phenylethyl)sulfanyl]-7H-purine #|AG-690/11240028|SR-01000531021-1|A2355/0099445

CAS: 5443-90-3
Molecular Formula C13H12N4S
Molecular Weight 256.07828 g/mol
LogP 2.9
Topological Polar Surface Area 79.8 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 256.07828
Monoisotopic Mass 256.07828
Heavy Atoms 18
Complexity 257.0

Chemical Identifiers

CAS Number 5443-90-3
SMILES C1=CC=C(C=C1)CCSC2=NC=NC3=C2NC=N3
InChIKey VCGOEBQQKCPKEN-UHFFFAOYSA-N

Product Overview

6-[(2-phenylethyl)sulfanyl]-9H-purine (CAS 5443-90-3), with molecular formula C13H12N4S and molecular weight 256.07828 g/mol. IUPAC: 6-(2-phenylethylsulfanyl)-7H-purine.

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